SCHEMBL6230815

SCHEMBL6230815

CCCc1c(F)ccc(O)c1O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
PRKCI P41743 1/20 0.38
PGAM1 P18669 1/20 0.36
MEP1B Q16820 1/20 0.36
ALOX5 P09917 2/20 0.35
F2RL1 P55085 3/20 0.35
TYR P14679 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6232748 0.88 HPGD (0.46) ALOX5TYRKDM4EALDH1A1HPGD
SCHEMBL13563242 0.87 F2RL1 (0.36) CNR1CNR2PRKCIPGAM1F2RL1
SCHEMBL13924219 0.82 PRKCI (0.44) PRKCIALOX5F2RL1TYRKDM4E
SCHEMBL5588615 0.77 PRKCI (0.52) CNR1CNR2PRKCIALOX5TYR
SCHEMBL5681133 0.77 NOS2 (0.41) CNR1CNR2PRKCIALOX5TYR
SCHEMBL7703634 0.76 ERN1 (0.50)
SCHEMBL7706281 0.75 TAAR1 (0.38) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL23491275 0.75 HPGD (0.44) ALOX5TYRKDM4EALDH1A1HPGD
SCHEMBL5680667 0.75 PRKCI (0.50) CNR1CNR2PRKCITYRKDM4E
SCHEMBL6233678 0.75 CNR1 (0.39) CNR1CNR2PRKCIPGAM1F2RL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed